Licochalcone A

CAS	58749-22-7
Structure
Synonyms	4′,4-Dihydroxy-3-α,α-dimethylallyl-6-methoxychalcone
IUPAC Name	(E)-3-[4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one
Molecular Weight	338.4
Molecular Formula	C21H22O4
Canonical SMILES	CC(C)(C=C)C1=C(C=C(C(=C1)/C=C/C(=O)C2=CC=C(C=C2)O)OC)O
InChI	InChI=1S/C21H22O4/c1-5-21(2,3)17-12-15(20(25-4)13-19(17)24)8-11-18(23)14-6-9-16(22)10-7-14/h5-13,22,24H,1H2,2-4H3/b11-8+
InChI Key	KAZSKMJFUPEHHW-DHZHZOJOSA-N
Boiling Point	532.6±50.0 °C
Melting Point	100 °C
Purity	98%
Density	1.171±0.06 g/ml
pKa	7.82±0.15
Appearance	Powder